Lanthanide appended rotaxanes respond to changing chloride concentration Clémence Allain, Paul Beer, Stephen Faulkner, Michael W. Jones, Alan M. Kenwright, Nathan Kilah, Richard C. Knighton, Thomas Just Sorensen, Manuel Tropiano
Chemical Science, 4 (1) Dec 2012 DOI: 10.1039/c2sc21614k Journal Paper I19-Small Molecule Single Crystal Diffraction open access Local structure, dynamics, and the mechanisms of oxide ionic conduction in Bi26Mo10O69 Chris D. Ling, Wojciech Miiller, Mark R. Johnson, Didier Richard, Stéphane Rols, Jim Madge, Ivana Evans
Chemistry Of Materials, 24 (23) Dec 2012 DOI: 10.1021/cm303202r Synthesis, characterization, MCD spectroscopy, and TD-DFT calculations of copper-metalated nonperipherally substituted octaoctyl derivatives of tetrabenzotriazaporphyrin, cis- and trans-tetrabenzodiazaporphyrin, tetrabenzomonoazaporphyrin... John Mack, Lydia Sosa-Vargas, Simon Coles, Graham Tizzard, Isabelle Chambrier, Andrew N. Cammidge, Michael J. Cook, Nagao Kobayashi
Inorganic Chemistry, 51 (23) Dec 2012 DOI: 10.1021/ic301712h Towards alternatives to anodic water oxidation: basket-handle thiolate FeIII porphyrins for electrocatalytic hydrocarbon oxidation Peiyi Li, Khalaf Alenezi, Saad K. Ibrahim, Joseph A. Wright, David L. Hughes, Christopher J. Pickett
Chemsuschem, 5 (12) Dec 2012 DOI: 10.1002/cssc.201200572 Small molecule, high impact: the role of water in the crystallization of paclitaxel Liana Vella-Zarb, Ulrich Baisch, Robert Dinnebier
Journal Of Pharmaceutical Sciences, 102 (2) Nov 2012 DOI: 10.1002/jps.23404 Versatile bottom-up approach to stapled π-conjugated helical scaffolds: synthesis and chiroptical properties of cyclic o-phenylene ethynylene oligomers Noelia Fuentes, Ana Martin-Lasanta, Luis Alvarez De Cienfuegos, Rafael Robles, Duane Choquesillo-Lazarte, Juan M. García-Ruiz, Lara Martínez-Fernández, Inés Corral, María Ribagorda, Antonio J. Mota, Diego J. Cárdenas, M. Carmen Carreño, Juan M. Cuerva
Angewandte Chemie International Edition, Nov 2012 DOI: 10.1002/anie.201206259 A homologous series of first-row transition-metal complexes of 2,2′-bipyridine and their ligand radical derivatives: trends in structure, magnetism, and bonding Mark Irwin, Laurence R. Doyle, Tobias Krämer, Radovan Herchel, John E. Mcgrady, Jose M. Goicoechea
Inorganic Chemistry, 51 (22) Nov 2012 DOI: 10.1021/ic301587f DetOx: a program for determining anomalous scattering factors of mixed-oxidation-state species Karim J. Sutton, Sarah A. Barnett, Kirsten E. Christensen, Harriott Nowell, Amber L. Thompson, David R. Allan, Richard I. Cooper
Journal Of Synchrotron Radiation, 20 Nov 2012 DOI: 10.1107/S0909049512044007 In situ beamline analysis and correction of active optics John Sutter, Simon Alcock, Kawal Sawhney
Journal Of Synchrotron Radiation, 19 (6) Nov 2012 DOI: 10.1107/S090904951203662X Journal Paper I02-Macromolecular Crystallography I03-Macromolecular Crystallography I04-Macromolecular Crystallography I15-Extreme Conditions I19-Small Molecule Single Crystal Diffraction I20-Scanning-X-ray spectroscopy (XAS/XES) I22-Small angle scattering & Diffraction Chemical transformations of a crystalline coordination polymer: a multi-stage solid-vapour reaction manifold Iñigo J. Vitórica-Yrezábal, Guillermo Mínguez Espallargas, Janet Soleimannejad, Alastair Florence, Ashleigh J. Fletcher, Lee Brammer
Chemical Science, 4 (2) Nov 2012 DOI: 10.1039/c2sc21654j Haloaurate and halopalladate imidazolium salts: structures, properties, and use as precursors for catalytic metal nanoparticles Christopher J. Serpell, James Cookson, Amber L. Thompson, Christopher M. Brown, Paul D. Beer
Dalton Transactions, Oct 2012 DOI: 10.1039/c2dt31984e Intergrown new zeolite beta polymorphs with interconnected 12-ring channels solved by combining electron crystallography and single-crystal X-ray diffraction Zheng-Bao Yu, Yu Han, Lan Zhao, Shiliang Huang, Qi-Yu Zheng, Shuangzheng Lin, Armando Córdova, Xiaodong Zou, Junliang Sun
Chemistry Of Materials, 24 (19) Sept 2012 DOI: 10.1021/cm301654d Coordination polymers utilizing N-oxide functionalized host ligands James J. Henkelis, Lindsay P. Harding, Michaele J. Hardie, Sarah A. Barnett
Inorganic Chemistry, 51 (20) Sept 2012 DOI: 10.1021/ic300940k Synthesis and characterization of a rhodium(I) σ-alkane complex in the solid state S. D. Pike, A. L. Thompson, A. G. Algarra, D. C. Apperley, S. A. Macgregor, A. S. Weller
Science, 337 Sept 2012 DOI: 10.1126/science.1225028 Solid state supramolecular chemistry: solid-gas reactions and intermolecular interactions Inigo J. Vitorica Yrezabal
Sept 2012 Thesis I11-High Resolution Powder Diffraction I19-Small Molecule Single Crystal Diffraction
A highly active bifunctional iridium complex with an alcohol/alkoxide-tethered N-heterocyclic carbene for alkylation of amines with alcohols Agnieszka Bartoszewicz, Rocío Marcos, Suman Sahoo, A. Ken Inge, Xiaodong Zou, Belén Martín-Matute
Chemistry - A European Journal, Sept 2012 DOI: 10.1002/chem.201201845 Journal Paper I19-Small Molecule Single Crystal Diffraction open access The structure of a complex open-framework germanate obtained by combining powder charge-flipping and simulated annealing A. Ken Inge, Shiliang Huang, Hong Chen, Francisca Moraga, Junliang Sun, Xiaodong Zou
Crystal Growth & Design, 12 (10) Sept 2012 DOI: 10.1021/cg300647s Journal Paper I11-High Resolution Powder Diffraction I19-Small Molecule Single Crystal Diffraction Chiral Ag(i) and Pt(ii) complexes of ditopic NHC ligands: synthesis, structural and spectroscopic properties Paul Marshall, Robert L. Jenkins, William Clegg, Ross Harrington, Samantha Callear, Simon Coles, Ian A. Fallis, Athanasia Dervisi
Dalton Transactions, 41 (41) Sept 2012 DOI: 10.1039/c2dt31740k Journal Paper I19-Small Molecule Single Crystal Diffraction open access Tautomerisation and polymorphism in molecular complexes of piroxicam with mono-substituted benzoic acids Craig Wales, Lynne H. Thomas, Chick C. Wilson
Crystengcomm, 14 (21) Aug 2012 DOI: 10.1039/c2ce26069g 42 salt forms of tyramine: structural comparison and the occurrence of hydrate formation Naomi E. B. Briggs, Alan R. Kennedy, Catriona A. Morrison
Acta Crystallographica Section B Structural Science, 68 (4) Aug 2012 DOI: 10.1107/S0108768112026456 A single crystal X-ray diffraction study of a fully ordered cocrystal of pristine Sc3N@D3h(5)–C78 Brandon Q. Mercado, Manuel N. Chaur, Luis Echegoyen, Jafar Attar Gharamaleki, Marilyn M. Olmstead, Alan L. Balch
Polyhedron, Aug 2012 DOI: 10.1016/j.poly.2012.08.035 Effect on charge transfer and charge recombination by insertion of a naphthalene-based bridge in molecular dyads based on borondipyrromethene (Bodipy) Andrew C. Benniston, Sophie Clift, Jerry Hagon, Helge Lemmetyinen, Nikolai V. Tkachenko, William Clegg, Ross W. Harrington
Chemphyschem, 13 (16) Aug 2012 DOI: 10.1002/cphc.201200510 Anion-induced reconstitution of a self-assembling system to express a chloride-binding Co10L15 pentagonal prism Imogen A. Riddell, Maarten M. J. Smulders, Jack K. Clegg, Yana R. Hristova, Boris Breiner, John D. Thoburn, Jonathan R. Nitschke
Nature Chemistry, 4 (9) Aug 2012 DOI: 10.1038/nchem.1407 Pressure-driven orbital reorientations and coordination-sphere reconstructions in [CuF2(H2O)2(pyz)] Alessandro Prescimone, Chelsey Morien, David Allan, John A. Schlueter, Stan W. Tozer, Jamie L. Manson, Simon Parsons, Euan K. Brechin, Stephen Hill
Angewandte Chemie International Edition, 51 (30) Jul 2012 DOI: 10.1002/anie.201202367 Jack of all trades: anion and transition metal binding by bis-triazole receptors Nicholas G. White, Paul D. Beer
Supramolecular Chemistry, 24 (7) Jul 2012 DOI: 10.1080/10610278.2012.688124 Can a C-H···O interaction be a determinant of conformation? Christopher R. Jones, Pranjal K. Baruah, Amber Thompson, Steve Scheiner, Martin D. Smith
Journal Of The American Chemical Society, 134 (29) Jul 2012 DOI: 10.1021/ja301318a Diastereoselective intermolecular ene reactions: synthesis of 4,5,6,7-tetrahydro-1H-benzo[d]imidazoles Michael J Hall, William Clegg, Ross W Harrington, Lynsey J Watson
Organic & Biomolecular Chemistry, 10 (33) Jul 2012 DOI: 10.1039/c2ob26009c Investigating the effect of macrocycle size in anion templated imidazolium-based interpenetrated and interlocked assemblies Graeme T. Spence, Nicholas G. White, Paul D. Beer
Organic & Biomolecular Chemistry, 10 (36) Jul 2012 DOI: 10.1039/c2ob26237a Synthesis of polyyne rotaxanes Levon D. Movsisyan, Dmitry V. Kondratiuk, Michael Franz, Amber L. Thompson, Rik R. Tykwinski, Harry L. Anderson
Organic Letters, 14 (13) Jul 2012 DOI: 10.1021/ol301392t Piezochromism in nickel salicylaldoximato complexes: tuning crystal-field splitting with high pressure Peter J. Byrne, Patricia J. Richardson, John Chang, Anna F. Kusmartseva, Dave Allan, Anita C. Jones, Konstantin V. Kamenev, Peter A. Tasker, Simon Parsons
Chemistry - A European Journal, 18 (25) June 2012 DOI: 10.1002/chem.201200213 Photochemical-mediated solid-state [2+2]-cycloaddition reactions of an unsymmetrical dibenzylidene acetone (monothiophos-dba) A. G. Jarvis, H. A. Sparkes, S. E. Tallentire, L. E. Hatcher, Mark R. Warren, P. R. Raithby, D. R. Allan, A. C. Whitwood, M. C. R. Cockett, S. B. Duckett, J. L. Clark, I. J. S. Fairlamb
Crystengcomm, 14 (17) June 2012 DOI: 10.1039/c2ce25480h A partially interpenetrated metal-organic framework for selective hysteretic sorption of carbon dioxide Sihai Yang, Xiang Lin, William Lewis, Mikhail Suyetin, Elena Bichoutskaia, Julia Parker, Chiu Tang, Dave Allan, Pierre J. Rizkallah, Peter Hubberstey, Neil R. Champness, K. Mark Thomas, Martin Schröder, Alexander J. Blake
Nature Materials, June 2012 DOI: 10.1038/nmat3343 Journal Paper I11-High Resolution Powder Diffraction I19-Small Molecule Single Crystal Diffraction Ultra-fast co-sensitization and tri-sensitization of dye-sensitized solar cells with N719, SQ1 and triarylamine dyes Peter Holliman, Moneer Mohsen, Arthur Connell, Matthew L Davies, Kareem Al-Salihi, Mateusz Pitak, Graham Tizzard, Simon Coles, Ross Harrington, Carlos Serpa, Octavio H Fontes, Cecile Charbonneau, Matthew J Carnie, William Clegg
Journal Of Materials Chemistry, 22 (26) June 2012 DOI: 10.1039/c2jm31314f Controlling magnetic communication through aromatic bridges by variation in torsion angle Thomas B. Faust, Floriana Tuna, Grigore A. Timco, Marco Affronte, Valerio Bellini, Wolfgang Wernsdorfer, Richard E. P. Winpenny
Dalton Transactions, June 2012 DOI: 10.1039/c2dt31292a Crossing the insulator-to-metal barrier with a thiazyl radical conductor Aaron Mailman, Stephen M. Winter, Xin Yu, Craig M. Robertson, Wenjun Yong, John S. Tse, Richard A. Secco, Zhenxian Liu, Paul A. Dube, Judith A. K. Howard, Richard T. Oakley
Journal Of The American Chemical Society, 134 (24) June 2012 DOI: 10.1021/ja303169y Applications of leverage analysis in structure refinement Simon Parsons, Trixie Wagner, Oliver Presly, Peter A. Wood, Richard I. Cooper
Journal Of Applied Crystallography, 45 (3) June 2012 DOI: 10.1107/S0021889812015191 SU-75: a disordered Ge10 germanate with pcu topology Shiliang Huang, A. Ken Inge, Sihai Yang, Kirsten Christensen, Xiaodong Zou, Junliang Sun
Dalton Transactions, 41 (40) June 2012 DOI: 10.1039/c2dt30767g Pentameric circular iron(II) double helicates and a molecular pentafoil knot Jean-François Ayme, Jonathon E. Beves, David Leigh, Roy T. Mcburney, Kari Rissanen, David Schultz
Journal Of The American Chemical Society, 134 June 2012 DOI: 10.1021/ja303355v Ion-pair recognition by a heteroditopic triazole-containing receptor Simon C. Picot, Benjamin R. Mullaney, Paul D. Beer
Chemistry - A European Journal, 18 (20) May 2012 DOI: 10.1002/chem.201200251 I19, the small-molecule single-crystal diffraction beamline at Diamond Light Source Harriott Nowell, Sarah A. Barnett, Kirsten E. Christensen, Simon J. Teat, David R. Allan
Journal Of Synchrotron Radiation, 19 (3) May 2012 DOI: 10.1107/S0909049512008801 Variation in supramolecular arrangements of hydrazones, o-H2NC6H4CMeNNHC6H4X (XH, o-, m- and p-NO2), derived from o-aminoacetophenone and phenylhydrazines R. Alan Howie, Thomas C. Baddeley, James L. Wardell, Solange M. S. V. Wardell
Journal Of Molecular Structure, 1020 Apr 2012 DOI: 10.1016/j.molstruc.2012.04.023 A chiral, self-catenating and porous metal-organic framework and its post-synthetic metal-uptake Michaele J. Hardie, Tia Jacobs, Rob Clowes, Andrew Cooper
Angewandte Chemie International Edition, 51 (21) Apr 2012 DOI: 10.1002/anie.201200758 Anion-induced shuttling of a naphthalimide triazolium rotaxane Graeme T. Spence, Mateusz B. Pitak, Paul D. Beer
Chemistry - A European Journal, 18 (23) Apr 2012 DOI: 10.1002/chem.201200317 Two novel Zn-MOFs: structures and characterization Ran Zheng, Lei Han, Qinhe Pan, Kirsten E. Christensen, Tiezhen Ren
Acta Crystallographica Section B Structural Science, 68 (2) Apr 2012 DOI: 10.1107/S0108768112007999 Air-stable, highly fluorescent primary phosphanes Laura H. Davies, Beverly Stewart, Ross W. Harrington, William Clegg, Lee J. Higham
Angewandte Chemie International Edition, 51 (20) Mar 2012 DOI: 10.1002/anie.201108416 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Lithol Red: a systematic structural study on salts of a sulfonated azo pigment Alan R. Kennedy, Heather Stewart, Katherine Eremin, Jens Stenger
Chemistry - A European Journal, 18 (10) Mar 2012 DOI: 10.1002/chem.201103027 Crystal engineering of energetic materials: Co-crystals of CL-20 David I. A. Millar, Helen E. Maynard-Casely, David R. Allan, Adam S. Cumming, Alistair R. Lennie, Alexandra J. Mackay, Iain D. H. Oswald, Chiu C. Tang, Colin R. Pulham
Crystengcomm, 14 (10) Mar 2012 DOI: 10.1039/c2ce05796d Journal Paper I11-High Resolution Powder Diffraction I19-Small Molecule Single Crystal Diffraction A ferrocene redox-active triazolium macrocycle that binds and senses chloride Nicholas G. White, Paul D Beer
Beilstein Journal Of Organic Chemistry, 8 Feb 2012 DOI: 10.3762/bjoc.8.25 Journal Paper I19-Small Molecule Single Crystal Diffraction open access Homo- and hetero-bimetallic complexes of TTHA Navpreet K. Sethi, Adrian C. Whitwood, Duncan W. Bruce
Polyhedron, 33 (1) Feb 2012 DOI: 10.1016/j.poly.2011.11.052 Aryl methyl sulfides as substrates for rhodium-catalyzed alkyne carbothiolation: arene functionalization with activating group recycling Joel F. Hooper, Adrian B. Chaplin, Carlos González-Rodríguez, Amber Thompson, Andrew Weller, Michael C. Willis
Journal Of The American Chemical Society, 134 Feb 2012 DOI: 10.1021/ja2108992 On the appearance of nitrite anion in [PdX(OAc)L2] and [Pd(X)(C^N)L] syntheses (X = OAc or NO2): photocrystallographic identification of metastable Pd(ç1-ONO)(C^N)PPh3 Somia E. Bajwa, Thomas E. Storr, Lauren E. Hatcher, Thomas J. Williams, Christoph G. Baumann, Adrian C. Whitwood, David R. Allan, Simon J. Teat, Paul R. Raithby, Ian J. S. Fairlamb
Chemical Science, 3 (5) Jan 2012 DOI: 10.1039/c2sc01050j A halogen-bonding catenane for anion recognition and sensing Antonio Caballero, Fabiola Zapata, Nicholas G. White, Paulo Costa, Vitor Felix, Paul D. Beer
Angewandte Chemie International Edition, 51 (8) Jan 2012 DOI: 10.1002/anie.201108404 Solution and surface-confined chloride anion templated redox-active ferrocene catenanes Nicholas H. Evans, Habibur Rahman, Alexandre V. Leontiev, Neil D. Greenham, Grzegorz A. Orlowski, Qiang Zeng, Robert M. J. Jacobs, Christopher J. Serpell, Nathan L. Kilah, Jason J. Davis, Paul D. Beer
Chemical Science, 3 (4) Jan 2012 DOI: 10.1039/c2sc00909a Helical scattering signatures of strain and electronic textures in YbFe2O4 from three-dimensional reciprocal-space imaging Alexander J. Hearmon, Dharmalingam Prabhakaran, Harriott Nowell, Federica Fabrizi, Matthias J. Gutmann, Paolo Radaelli
Physical Review B, 85 (1) Jan 2012 DOI: 10.1103/PhysRevB.85.014115 Amide and urea ferrocene-containing macrocycles capable of the electrochemical sensing of anions Nicholas H. Evans, Chris Serpell, Kirsten Christensen, Paul D. Beer
European Journal Of Inorganic Chemistry, 2012 (6) Jan 2012 DOI: 10.1002/ejic.201101257 Screening for cocrystals of succinic acid and 4-aminobenzoic acid Nizar Issa, Sharmarke Mohamed, Doris E. Braun, Royston C. B. Copley, Derek A. Tocher, Sarah L. Price, Sarah A. Barnett
Crystengcomm, 14 (7) Jan 2012 DOI: 10.1039/c2ce06325e